A comparative DFT study of MgFe2O4 and MnFe2O4 spinel ferrites at various pressures to investigate the structural, mechanical, electronic, magnetic and optical properties for multifunctional applications
Shamim Akhtar, Abid Hussain, Shahzadi Noreen, Nazia Bibi, Muhammad Bilal Tahir, Jalil Ur Rehman
Topics & Concepts
CASTEPChemistryMagnetic momentFerrite (magnet)Band gapDensity functional theoryLattice constantSpinelIonic bondingCondensed matter physicsOptoelectronicsMaterials scienceComposite materialMetallurgyComputational chemistryOpticsIonDiffractionPhysicsOrganic chemistryMagnetic Properties and Synthesis of FerritesAdvancements in Battery MaterialsElectromagnetic wave absorption materials